F1110-0067
TL;DR: F1110-0067 (CAS 683250-60-4) is a chemical compound with molecular formula C22H17N3O6S and molecular weight 451.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-2-cyano-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]-2,6-dimethoxyphenyl] acetate
Also Known As: F1110-0067, 4-[(1E)-2-cyano-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]eth-1-en-1-yl]-2,6-dimethoxyphenyl acetate, (E)-4-(2-cyano-2-(4-(3-nitrophenyl)thiazol-2-yl)vinyl)-2,6-dimethoxyphenyl acetate, [4-[(E)-2-cyano-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]-2,6-dimethoxyphenyl] acetate, [4-[2-cyano-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]-2,6-dimethoxy-phenyl] Acetate
| Molecular Formula | C22H17N3O6S |
|---|---|
| Molecular Weight | 451.08 g/mol |
| LogP | 4.72498 |
| Topological Polar Surface Area | 124.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 451.0838 |
| Heavy Atoms | 32 |
| Complexity | 1233.5424 |
Chemical Identifiers
| CAS Number | 683250-60-4 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1OC)/C=C(\C#N)/C2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])OC |
Product Overview
F1110-0067 (CAS 683250-60-4), with molecular formula C22H17N3O6S and molecular weight 451.08 g/mol. IUPAC: [4-[(E)-2-cyano-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]-2,6-dimethoxyphenyl] acetate.
Chemical Property Profile of F1110-0067
Property Insights of F1110-0067
The XLogP value of 4.72498 indicates that F1110-0067 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.58 Ų falls within the moderate polarity range, balancing permeability and solubility for F1110-0067. Following Lipinski's Rule of Five, F1110-0067 has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1110-0067?
The CAS number of F1110-0067 is 683250-60-4.
What is the molecular formula of F1110-0067?
The molecular formula of F1110-0067 is C22H17N3O6S.
What is the molecular weight of F1110-0067?
The molecular weight of F1110-0067 is 451.08 g/mol.
Where can I buy F1110-0067?
You can request a quote for F1110-0067 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1110-0067?
Yes, KEHONG BIO provides custom synthesis services for F1110-0067 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.